(2Z)-3-ethyl-5,7-dimethyl-2-[(7-methyl-1-prop-2-enyl-quinolin-1-ium-2-yl)methylidene]-1,3-benzothiazole

Systemtic Name: (2Z)-3-ethyl-5,7-dimethyl-2-[(7-methyl-1-prop-2-enyl-quinolin-1-ium-2-yl)methylidene]-1,3-benzothiazole Openeye Name: (2Z)-2-[(1-allyl-7-methyl-quinolin-1-ium-2-yl)methylene]-3-ethyl-5,7-dimethyl-1,3-benzothiazole CAS Name: (2Z)-3-ethyl-5,7-dimethyl-2-[(7-methyl-1-prop-2-enyl-2-quinolin-1-iumyl)methylidene]-1,3-benzothiazole IUPAC Name: (2Z)-3-ethyl-5,7-dimethyl-2-[(7-methyl-1-prop-2-enylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazole Traditional Name: (2Z)-2-[(1-allyl-7-methyl-quinolin-1-ium-2-yl)methylene]-3-ethyl-5,7-dimethyl-1,3-benzothiazole Formula: C25H27N2S+ MolecularWeight: 387.56028

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC(=CC(=C2SC1=CC3=[N+](C4=C(C=CC(=C4)C)C=C3)CC=C)C)C

Isomeric SMILES

CCN\1C2=CC(=CC(=C2S/C1=C\C3=[N+](C4=C(C=CC(=C4)C)C=C3)CC=C)C)C

InChI

InChI=1S/C25H27N2S/c1-6-12-27-21(11-10-20-9-8-17(3)14-22(20)27)16-24-26(7-2)23-15-18(4)13-19(5)25(23)28-24/h6,8-11,13-16H,1,7,12H2,2-5H3/q+1